orbital_charges     :real:2:4,6
  0.692145534488657E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.174045518651433E+001  0.156215210982446E+001
  0.199999999651128E+001  0.131945303811826E+001  0.173569887748097E+001
  0.179877421019196E+001  0.118760553213991E+001  0.186709819496233E+001
  0.708174282251238E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.694221518758309E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.694221518758309E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,6
  0.158042571974526E-002 -0.512331855111799E-003  0.174014448683923E-016
  0.641381451698855E-003 -0.107565386800762E-003  0.160258633620514E-016
 -0.515499148759091E-003  0.310025055266144E-003 -0.902056207507940E-016
 -0.473781230082224E-003  0.415787176657828E-003 -0.328725016499921E-016
 -0.616263396301393E-003 -0.529574950055428E-004 -0.666292459300916E-003
 -0.616263396301421E-003 -0.529574950058065E-004  0.666292459301027E-003
mermin_energy       :real:0:
 -0.816523899681050E+001
end_coords          :real:2:3,6
 -0.944362216902488E+000 -0.121490483805739E-001  0.000000000000000E+000
 -0.277231684236674E+001 -0.278628758660031E+000  0.000000000000000E+000
  0.263153225621761E+001  0.253125016718170E+000  0.000000000000000E+000
 -0.354685316412762E+001  0.137925997646206E+001  0.000000000000000E+000
  0.328270915517005E+001 -0.614444405186437E+000 -0.147306597453512E+001
  0.328270915517005E+001 -0.614444405186437E+000  0.147306597453512E+001
